N-(furan-2-ylmethyl)-2,4-dimethoxy-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2,4-dimethoxy-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]benzamide Openeye Name: N-(2-furylmethyl)-N-[[2-(4-hydroxy-1-piperidyl)-7-methylsulfanyl-3-quinolyl]methyl]-2,4-dimethoxy-benzamide CAS Name: N-(2-furanylmethyl)-N-[[2-(4-hydroxy-1-piperidinyl)-7-(methylthio)-3-quinolinyl]methyl]-2,4-dimethoxybenzamide IUPAC Name: N-(furan-2-ylmethyl)-N-[[2-(4-hydroxypiperidin-1-yl)-7-methylsulfanylquinolin-3-yl]methyl]-2,4-dimethoxybenzamide Traditional Name: N-(2-furfuryl)-N-[[2-(4-hydroxypiperidino)-7-(methylthio)-3-quinolyl]methyl]-2,4-dimethoxy-benzamide Formula: C30H33N3O5S MolecularWeight: 547.66512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)N5CCC(CC5)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)N5CCC(CC5)O)OC

InChI

InChI=1S/C30H33N3O5S/c1-36-23-7-9-26(28(16-23)37-2)30(35)33(19-24-5-4-14-38-24)18-21-15-20-6-8-25(39-3)17-27(20)31-29(21)32-12-10-22(34)11-13-32/h4-9,14-17,22,34H,10-13,18-19H2,1-3H3